4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline

C15H17N3O — CID 18161

IUPAC4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline
SMILESCOc1ccccc1/N=N/c1ccc(N(C)C)cc1
InChIInChI=1S/C15H17N3O/c1-18(2)13-10-8-12(9-11-13)16-17-14-6-4-5-7-15(14)19-3/h4-11H,1-3H3/b17-16+
InChIKeyCZEMWOVPKVMGOV-WUKNDPDISA-N
MW255.32 g/mol
LogP4.18
Rot. Bonds4

About 4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline

4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline (PubChem CID 18161) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline
PubChem CID18161
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline
SMILESCOc1ccccc1/N=N/c1ccc(N(C)C)cc1
InChIInChI=1S/C15H17N3O/c1-18(2)13-10-8-12(9-11-13)16-17-14-6-4-5-7-15(14)19-3/h4-11H,1-3H3/b17-16+
InChIKeyCZEMWOVPKVMGOV-WUKNDPDISA-N
XLogP4.18
TPSA37.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

bis(2-methoxyphenyl)diazene
CID 11947
(2-methoxy-4-methylphenyl)-[4-[(2-methoxyphenyl)diazenyl]phenyl]diazene
CID 156523555
4-[(4-dimethoxysilylphenyl)diazenyl]-N,N-dimethylaniline
CID 159881311
4-[(4-iodophenyl)diazenyl]-N,N-dimethylaniline
CID 577894
4-[(4-chlorophenyl)diazenyl]-N,N-dimethylaniline
CID 17226
4-[[4-(dimethylamino)phenyl]diazenyl]benzene-1,2,3-triol
CID 136714423
2-[(4-fluorophenyl)diazenyl]-N,N-dimethylaniline
CID 170987598
tris(ethenyl)stannyl 2-[[4-(dimethylamino)phenyl]diazenyl]benzoate
CID 16688235
3-ethenyl-N,N-dimethyl-4-phenyldiazenylaniline
CID 102247917
1-methoxy-2-(sulfinylamino)benzene
CID 598052
N,N-dimethyl-4-[(4-methylsulfanylphenyl)diazenyl]aniline
CID 145427736
4-[[4-(dimethylamino)phenyl]diazenyl]naphthalene-1-sulfonyl chloride
CID 14513518

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline?
The IUPAC name of 4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline (CID 18161) is 4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline?
The canonical SMILES for 4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline is COc1ccccc1/N=N/c1ccc(N(C)C)cc1.
What is the InChIKey of 4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline?
The InChIKey is CZEMWOVPKVMGOV-WUKNDPDISA-N. The full InChI is InChI=1S/C15H17N3O/c1-18(2)13-10-8-12(9-11-13)16-17-14-6-4-5-7-15(14)19-3/h4-11H,1-3H3/b17-16+.
What are the key properties of 4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline?
4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline has a molecular weight of 255.32 g/mol, XLogP of 4.18, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methoxyphenyl)diazenyl]-N,N-dimethylaniline is sourced from PubChem (CID 18161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).